1-nitroso-3,5-diphenylimidazolidine-2,4-dione

C15H11N3O3 — CID 13306016

IUPAC1-nitroso-3,5-diphenylimidazolidine-2,4-dione
SMILESO=NN1C(=O)N(c2ccccc2)C(=O)C1c1ccccc1
InChIInChI=1S/C15H11N3O3/c19-14-13(11-7-3-1-4-8-11)18(16-21)15(20)17(14)12-9-5-2-6-10-12/h1-10,13H
InChIKeyDAOAYXZPYSKACY-UHFFFAOYSA-N
MW281.27 g/mol
LogP2.88
Rot. Bonds3

About 1-nitroso-3,5-diphenylimidazolidine-2,4-dione

1-nitroso-3,5-diphenylimidazolidine-2,4-dione (PubChem CID 13306016) has the molecular formula C15H11N3O3 and a molecular weight of 281.27 g/mol. Its IUPAC name is 1-nitroso-3,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name1-nitroso-3,5-diphenylimidazolidine-2,4-dione
PubChem CID13306016
Molecular FormulaC15H11N3O3
Molecular Weight281.27 g/mol
Exact Mass281.08
IUPAC Name1-nitroso-3,5-diphenylimidazolidine-2,4-dione
SMILESO=NN1C(=O)N(c2ccccc2)C(=O)C1c1ccccc1
InChIInChI=1S/C15H11N3O3/c19-14-13(11-7-3-1-4-8-11)18(16-21)15(20)17(14)12-9-5-2-6-10-12/h1-10,13H
InChIKeyDAOAYXZPYSKACY-UHFFFAOYSA-N
XLogP2.88
TPSA70.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.27
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'N-nitroso', 'substructure': 'N/A'}

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Related Compounds

(5S)-1,3,5-triphenylimidazolidine-2,4-dione
CID 154708380
2-(2,4-dioxo-3,5-diphenylimidazolidin-1-yl)acetic acid
CID 19087968
2,4,6-trioxo-1,3-diphenyl-1,3-diazinane-5-carbaldehyde
CID 2784820
3-(3,5-dichlorophenyl)-1-methyl-5-phenylimidazolidine-2,4-dione
CID 86820061
16-phenyl-16-azatetracyclo[6.6.3.02,7.09,14]heptadeca-2,4,6,9,11,13-hexaene-15,17-dione
CID 102335192
(7aR)-3,6-diphenyl-3,7a-dihydro-1H-imidazo[1,5-c][1,3]thiazole-5,7-dione
CID 59885924
(3aR,4S,7S,7aS)-2,4,7-triphenyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 100871293
2-methyl-1,3,5-triphenyl-1,3,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-4,6-dione
CID 15019688
(4E)-4-benzylidene-1,3-diphenylazetidin-2-one
CID 50943990
1,4-diphenylpiperidine-2,6-dione
CID 2812798
1,5-diphenyl-3-tritylimidazolidine-2,4-dione
CID 44614596
(3S)-2-oxo-1-phenyl-3H-indole-3-carbaldehyde
CID 1070648

Frequently Asked Questions

What is the IUPAC name of 1-nitroso-3,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 1-nitroso-3,5-diphenylimidazolidine-2,4-dione (CID 13306016) is 1-nitroso-3,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 1-nitroso-3,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 1-nitroso-3,5-diphenylimidazolidine-2,4-dione is O=NN1C(=O)N(c2ccccc2)C(=O)C1c1ccccc1.
What is the InChIKey of 1-nitroso-3,5-diphenylimidazolidine-2,4-dione?
The InChIKey is DAOAYXZPYSKACY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O3/c19-14-13(11-7-3-1-4-8-11)18(16-21)15(20)17(14)12-9-5-2-6-10-12/h1-10,13H.
What are the key properties of 1-nitroso-3,5-diphenylimidazolidine-2,4-dione?
1-nitroso-3,5-diphenylimidazolidine-2,4-dione has a molecular weight of 281.27 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-nitroso-3,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 13306016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).